3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)pyridin-4-one

Systemtic Name: 3-[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)pyridin-4-one Openeye Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)pyridin-4-one CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)-4-pyridinone IUPAC Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)pyridin-4-one Traditional Name: 3-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-2-(methoxymethyl)-6-methyl-1-(3-phenylpropyl)-4-pyridone Formula: C30H37N3O3 MolecularWeight: 487.63308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=C(N(C(=CC3=O)C)CCCC4=CC=CC=C4)COC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=C(N(C(=CC3=O)C)CCCC4=CC=CC=C4)COC

InChI

InChI=1S/C30H37N3O3/c1-22-12-13-23(2)26(19-22)31-15-17-32(18-16-31)30(35)29-27(21-36-4)33(24(3)20-28(29)34)14-8-11-25-9-6-5-7-10-25/h5-7,9-10,12-13,19-20H,8,11,14-18,21H2,1-4H3